Information card for entry 7715525
Formula |
C2 H7 F3 N O2 P |
Calculated formula |
C2 H7 F3 N O2 P |
Title of publication |
Transition Metal Complexes of the (2,2,2-Trifluoroethyl)phosphinate NOTA Analogue as Potential Contrast Agents for 19F Magnetic Resonance Imaging |
Authors of publication |
Koucký, Filip; Dobrovolná, Tereza; Kotek, Jan; Cisarova, Ivana; Havlickova, Jana; Liška, Alan; Kubicek, Vojtech; Hermann, Petr |
Journal of publication |
Dalton Transactions |
Year of publication |
2024 |
a |
7.349 ± 0.0004 Å |
b |
11.7365 ± 0.0006 Å |
c |
15.2447 ± 0.0008 Å |
α |
90° |
β |
90° |
γ |
90° |
Cell volume |
1314.88 ± 0.12 Å3 |
Cell temperature |
120 ± 2 K |
Ambient diffraction temperature |
120 ± 2 K |
Number of distinct elements |
6 |
Space group number |
61 |
Hermann-Mauguin space group symbol |
P b c a |
Hall space group symbol |
-P 2ac 2ab |
Residual factor for all reflections |
0.0259 |
Residual factor for significantly intense reflections |
0.0259 |
Weighted residual factors for significantly intense reflections |
0.0759 |
Weighted residual factors for all reflections included in the refinement |
0.0759 |
Goodness-of-fit parameter for all reflections included in the refinement |
1.101 |
Diffraction radiation wavelength |
1.54178 Å |
Diffraction radiation type |
CuKα |
Has coordinates |
Yes |
Has disorder |
No |
Has Fobs |
No |
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https://www.crystallography.net/7715525.html